N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]propanamide CAS Name: 3-(benzenesulfonyl)-N-[2-[(2-cyanophenyl)methylthio]ethyl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]propanamide Traditional Name: 3-besyl-N-[2-[(2-cyanobenzyl)thio]ethyl]propionamide Formula: C19H20N2O3S2 MolecularWeight: 388.5037

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCC(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C19H20N2O3S2/c20-14-16-6-4-5-7-17(16)15-25-12-11-21-19(22)10-13-26(23,24)18-8-2-1-3-9-18/h1-9H,10-13,15H2,(H,21,22)